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Ligand

NameCHEMBL12059
Molecular formulaC14H16N4S2
IUPAC namemethyl N-cyano-N'-[2-(1H-indol-3-ylmethylsulfanyl)ethyl]carbamimidothioate
Molecular weight304.43
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.9
SynonymsN/A
Inchi KeyAMASEONOXOVLBI-UHFFFAOYSA-N
Inchi IDInChI=1S/C14H16N4S2/c1-19-14(18-10-15)16-6-7-20-9-11-8-17-13-5-3-2-4-12(11)13/h2-5,8,17H,6-7,9H2,1H3,(H,16,18)
PubChem CID44267899
ChEMBLCHEMBL12059
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8706Histamine H2 receptorP47747HRH2Cavia porcellus (Guinea pig)359

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